ChemSpider 2D Image | (3E,3'E)-2-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-1,1'-dihydroxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-psi,psi-caroten-2'-yl 6-deoxy-alpha-L-mannopyranoside | C52H76O12

(3E,3'E)-2-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1,1'-dihydroxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-ψ,ψ-caroten-2'-yl 6-deoxy-α-L-mannopyranoside

  • Molecular FormulaC52H76O12
  • Average mass893.153 Da
  • Monoisotopic mass892.533691 Da
  • ChemSpider ID59699959

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 12 of 12 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3E,3'E)-2-[(6-Deoxy-α-L-mannopyranosyl)oxy]-1,1'-dihydroxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-ψ,ψ-caroten-2'-yl 6-deoxy-α-L-mannopyranoside [ACD/IUPAC Name]
(3E,3'E)-2-[(6-Desoxy-α-L-mannopyranosyl)oxy]-1,1'-dihydroxy-3,3',4,4'-tetradehydro-1,1',2,2'-tetrahydro-ψ,ψ-carotin-2'-yl-6-desoxy-α-L-mannopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranoside de (3E,3'E)-2-[(6-désoxy-α-L-mannopyranosyl)oxy]-1,1'-dihydroxy-3,3',4,4'-tétradéhydro-1,1',2,2'-tétrahydro-ψ,ψ-carotén-2'-yle [French] [ACD/IUPAC Name]
α-L-Mannopyranoside, (3E,3'E)-3,3',4,4'-tetradehydro-2-[(6-deoxy-α-L-mannopyranosyl)oxy]-1,1',2,2'-tetrahydro-1,1'-dihydroxy-ψ,ψ-caroten-2'-yl 6-deoxy- [ACD/Index Name]
2,2'-Di-(α-L-Rhamnosyloxy)-3,4,3',4'-tetradehydro-1,2,1',2'-tetrahydro-ψ,ψ-carotene-1,1'-diol
Oscillol 2,2'-dirhamnoside

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 1027.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 170.0±6.0 kJ/mol
Flash Point: 575.1±34.3 °C
Index of Refraction: 1.590
Molar Refractivity: 255.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 4
ACD/LogP: 10.40
ACD/LogD (pH 5.5): 6.88
ACD/BCF (pH 5.5): 100065.57
ACD/KOC (pH 5.5): 132063.38
ACD/LogD (pH 7.4): 6.88
ACD/BCF (pH 7.4): 100064.47
ACD/KOC (pH 7.4): 132061.92
Polar Surface Area: 199 Å2
Polarizability: 101.2±0.5 10-24cm3
Surface Tension: 54.8±5.0 dyne/cm
Molar Volume: 755.9±5.0 cm3

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